Information card for entry 4509543

Structure parameters

• Formula: C84 H58 N3 O12 P2 Tb
• Calculated formula: C84 H58 N3 O12 P2 Tb
• SMILES: c12O[Tb]345([O]=C(c6c(O4)onc6c4ccccc4)c4ccccc4)([O]=C(c1c(no2)c1ccccc1)c1ccccc1)(Oc1c(C(=[O]3)c2ccccc2)c(no1)c1ccccc1)[O]=P(c1ccccc1)(c1ccccc1)c1ccccc1Oc1ccccc1P(c1ccccc1)(c1ccccc1)=[O]5
• Title of publication: Molecular Ladders of Lanthanide-3-phenyl-4-benzoyl-5-isoxazolonate and Bis(2-(diphenylphosphino)phenyl) Ether Oxide Complexes: The Role of the Ancillary Ligand in the Sensitization of Eu3+and Tb3+Luminescence
• Authors of publication: Biju, S.; Reddy, M. L. P.; Cowley, Alan H.; Vasudevan, Kalyan V.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2009
• Journal volume: 9
• Journal issue: 8
• Pages of publication: 3562
• a: 12.377 ± 0.003 Å
• b: 12.833 ± 0.003 Å
• c: 23.51 ± 0.005 Å
• α: 100.58 ± 0.03°
• β: 95.75 ± 0.03°
• γ: 107.52 ± 0.03°
• Cell volume: 3452 ± 1.6 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1151
• Residual factor for significantly intense reflections: 0.064
• Weighted residual factors for significantly intense reflections: 0.1009
• Weighted residual factors for all reflections included in the refinement: 0.1157
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No